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Ligand

NameCHEMBL246735
Molecular formulaC22H20ClN3O6
IUPAC name4-[4-[4-[1-(2-chlorophenyl)ethoxycarbonylamino]-1,2-oxazol-3-yl]anilino]-4-oxobutanoic acid
Molecular weight457.867
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP2.7
Synonyms4-(4-(4-((1-(2-chlorophenyl)ethoxy)carbonyl)isoxazol-3-yl)phenylamino)-4-oxobutanoic acid
BDBM50211655
OMOMFBJGKABUGF-UHFFFAOYSA-N
4-[(4-{4-[1-(2-chlorophenyl)ethoxycarbonylamino]-3-isoxazolyl}phenyl)amino]-4-oxobutanoic Acid
SCHEMBL4025130
Inchi KeyOMOMFBJGKABUGF-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20ClN3O6/c1-13(16-4-2-3-5-17(16)23)32-22(30)25-18-12-31-26-21(18)14-6-8-15(9-7-14)24-19(27)10-11-20(28)29/h2-9,12-13H,10-11H2,1H3,(H,24,27)(H,25,30)(H,28,29)
PubChem CID11167018
ChEMBLCHEMBL246735
IUPHARN/A
BindingDB50211655
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
245086Lysophosphatidic acid receptor 1P61794Lpar1Rattus norvegicus (Rat)364
245087Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364

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